SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3wi5'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HWI_C_115C4_1
(HMG-COA REDUCTASE)		 3wi5 MAJOR OUTER MEMBRANE
PROTEIN P.IB
(Neisseria
meningitidis) 		4 / 7 VAL A 143
SER A 142
ASN A 164
ASP A 100
 None
 1.37A 1hwiC-3wi5A:
undetectable		 1hwiC-3wi5A:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HWI_D_115D3_2
(HMG-COA REDUCTASE)		 3wi5 MAJOR OUTER MEMBRANE
PROTEIN P.IB
(Neisseria
meningitidis) 		4 / 7 VAL A 143
SER A 142
ASN A 164
ASP A 100
 None
 1.37A 1hwiD-3wi5A:
undetectable		 1hwiD-3wi5A:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1K4T_D_TTCD990_1
(DNA TOPOISOMERASE I)		 3wi5 MAJOR OUTER MEMBRANE
PROTEIN P.IB
(Neisseria
meningitidis) 		4 / 5 GLU A 123
ARG A 130
LYS A  88
ASP A 132
 None
 1.29A 1k4tA-3wi5A:
undetectable		 1k4tA-3wi5A:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RR8_A_TTCA100_1
(DNA TOPOISOMERASE I)		 3wi5 MAJOR OUTER MEMBRANE
PROTEIN P.IB
(Neisseria
meningitidis) 		4 / 5 GLU A 123
ARG A 130
LYS A  88
ASP A 132
 None
 1.32A 1rr8C-3wi5A:
undetectable		 1rr8C-3wi5A:
20.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RRJ_B_TTCB990_1
(DNA TOPOISOMERASE I)		 3wi5 MAJOR OUTER MEMBRANE
PROTEIN P.IB
(Neisseria
meningitidis) 		4 / 5 GLU A 123
ARG A 130
LYS A  88
ASP A 132
 None
 1.28A 1rrjA-3wi5A:
undetectable		 1rrjA-3wi5A:
20.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3O7W_A_SAMA801_1
(LEUCINE CARBOXYL
METHYLTRANSFERASE 1)		 3wi5 MAJOR OUTER MEMBRANE
PROTEIN P.IB
(Neisseria
meningitidis) 		3 / 3 LYS A  99
ARG A 125
ASP A 108
 FLC  A 401 (-3.4A)
FLC  A 401 (-3.7A)
None
 1.00A 3o7wA-3wi5A:
undetectable		 3o7wA-3wi5A:
23.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D9H_A_ADNA301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 3wi5 MAJOR OUTER MEMBRANE
PROTEIN P.IB
(Neisseria
meningitidis) 		5 / 11 GLY A 115
VAL A 116
GLU A 123
SER A 109
VAL A 271
 None
 1.26A 4d9hA-3wi5A:
undetectable		 4d9hA-3wi5A:
23.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DA6_A_GA2A301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 3wi5 MAJOR OUTER MEMBRANE
PROTEIN P.IB
(Neisseria
meningitidis) 		5 / 9 GLY A 115
VAL A 116
GLU A 123
SER A 109
VAL A 271
 None
 1.23A 4da6A-3wi5A:
undetectable		 4da6A-3wi5A:
23.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DA7_A_AC2A301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 3wi5 MAJOR OUTER MEMBRANE
PROTEIN P.IB
(Neisseria
meningitidis) 		5 / 10 GLY A 115
VAL A 116
GLU A 123
SER A 109
VAL A 271
 None
 1.23A 4da7A-3wi5A:
undetectable		 4da7A-3wi5A:
23.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DAN_B_2FAB301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 3wi5 MAJOR OUTER MEMBRANE
PROTEIN P.IB
(Neisseria
meningitidis) 		5 / 12 GLY A 115
VAL A 116
GLU A 123
SER A 109
VAL A 271
 None
 1.24A 4danA-3wi5A:
undetectable
4danB-3wi5A:
undetectable		 4danA-3wi5A:
23.10
4danB-3wi5A:
23.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B2S_A_ACTA107_0
(CRISPR-ASSOCIATED
ENDONUCLEASE CAS9
GUIDE RNA)		 3wi5 MAJOR OUTER MEMBRANE
PROTEIN P.IB
(Neisseria
meningitidis) 		3 / 3 VAL A  29
THR A  31
ARG A  17
 None
 0.77A 5b2sB-3wi5A:
undetectable		 5b2sB-3wi5A:
12.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B2T_A_ACTA108_0
(CRISPR-ASSOCIATED
ENDONUCLEASE CAS9
GUIDE RNA)		 3wi5 MAJOR OUTER MEMBRANE
PROTEIN P.IB
(Neisseria
meningitidis) 		3 / 3 VAL A  29
THR A  31
ARG A  17
 None
 0.77A 5b2tB-3wi5A:
undetectable		 5b2tB-3wi5A:
12.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5YW0_A_ACTA410_0
(UNCHARACTERIZED
PROTEIN KDOO)		 3wi5 MAJOR OUTER MEMBRANE
PROTEIN P.IB
(Neisseria
meningitidis) 		4 / 4 GLY A  12
LEU A  38
VAL A  36
GLU A  14
 None
 1.47A 5yw0A-3wi5A:
undetectable		 5yw0A-3wi5A:
23.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BPL_B_PA1B605_1
(LIPID A EXPORT
ATP-BINDING/PERMEASE
PROTEIN MSBA)		 3wi5 MAJOR OUTER MEMBRANE
PROTEIN P.IB
(Neisseria
meningitidis) 		3 / 3 ARG A 310
ARG A 240
ARG A 247
 None
 1.08A 6bplA-3wi5A:
undetectable
6bplB-3wi5A:
undetectable		 6bplA-3wi5A:
15.15
6bplB-3wi5A:
15.15